SCHEMBL9775919

SCHEMBL9775919

O=C(O)c1cn(CCF)c2nc3cc(Cl)c(F)cc3cc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.43
CYP2C9 P11712 1/20 0.43
ATP6V1B2 P21281 1/20 0.43
TBXA2R P21731 1/20 0.43
EDNRA P25101 1/20 0.43
TARBP2 Q15633 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.40
ABCC4 O15439 1/20 0.40
PKM P14618 1/20 0.40
PTGS1 P23219 1/20 0.40
KMT2A Q03164 1/20 0.40
EGLN1 Q9GZT9 1/20 0.38
TSHR P16473 1/20 0.38
HIF1A Q16665 1/20 0.38
DRD3 P35462 1/20 0.36
CHRM1 P11229 2/20 0.36
DPP4 P27487 1/20 0.36
CASP1 P29466 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9786233 0.91 LMNA (0.46) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL7229905 0.89 LMNA (0.55) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9775880 0.86 KMT2A (0.45) LMNAKDM4EALDH1A1MEN1KMT2A
SCHEMBL7230355 0.85 LMNA (0.39) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9785206 0.84 LMNA (0.44) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL28331885 0.82 KDM4E (0.52) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL7235145 0.81 CYP2C9 (0.37) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9775969 0.81 ALDH1A1 (0.67) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL9775979 0.80 TOP2A (0.37) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8942028 0.79 LMNA (0.59) LMNACYP2C9ATP6V1B2TBXA2REDNRA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5004745-A Benzo[1,8]naphthyridine derivatives, their preparation and the compositions which contain them LABORATOIRE ROGER BELLON (FR) 1991-04-02 US disclosed
US-4990515-A Chemical intermediates RHONE-POULENC SANTE (FR) 1991-02-05 US disclosed
US-4970213-A Benzo(1,8)naphthyridine derivatives as intermediates RHONE-POULENC SANTE (FR) 1990-11-13 US disclosed